1-butyl-2-propylsulfonyl-4-(2,4,4-trimethylpentan-2-yl)benzene

Systemtic Name: 1-butyl-2-propylsulfonyl-4-(2,4,4-trimethylpentan-2-yl)benzene Openeye Name: 1-butyl-2-propylsulfonyl-4-(1,1,3,3-tetramethylbutyl)benzene CAS Name: 1-butyl-2-propylsulfonyl-4-(2,4,4-trimethylpentan-2-yl)benzene IUPAC Name: 1-butyl-2-propylsulfonyl-4-(2,4,4-trimethylpentan-2-yl)benzene Traditional Name: 1-butyl-2-propylsulfonyl-4-(1,1,3,3-tetramethylbutyl)benzene Formula: C21H36O2S MolecularWeight: 352.57434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C=C(C=C1)C(C)(C)CC(C)(C)C)S(=O)(=O)CCC

Isomeric SMILES

CCCCC1=C(C=C(C=C1)C(C)(C)CC(C)(C)C)S(=O)(=O)CCC

InChI

InChI=1S/C21H36O2S/c1-8-10-11-17-12-13-18(21(6,7)16-20(3,4)5)15-19(17)24(22,23)14-9-2/h12-13,15H,8-11,14,16H2,1-7H3